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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:4938 - Eupatoroxin
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ChEBI Ontology
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ChEBI Name
Eupatoroxin
ChEBI ID
CHEBI:4938
Stars
This entity has been manually annotated by a third party.
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Formula
C20H24O8
Net Charge
0
Average Mass
392.401
Monoisotopic Mass
392.14712
InChI
InChI=1S/C20H24O8/c1-
5-
8(2)
16(22)
26-
10-
6-
19(7-
25-
19)
13-
12(21)
15-
18(4,28-
15)
20(13,24)
14-
11(10)
9(3)
17(23)
27-
14/h5,10-
15,21,24H,3,6-
7H2,1-
2,4H3/b8-
5-
/t10-
,11-
,12+,13+,14+,15-
,18-
,19+,20-
/m1/s1
InChIKey
QUSNLLJZMPVTTC-ZDHOEGKISA-N
SMILES
C\C=C(\C)C(=O)O[C@@H]1C[C@]2(CO2)[C@@H]2[C@H](O)[C@H]3O[C@@]3(C)[C@]2(O)[C@H]2OC(=O)C(=C)[C@H]12
ChEBI Ontology
Outgoing
Eupatoroxin (
CHEBI:4938
)
is a
sesquiterpene lactone (
CHEBI:37667
)
Synonym
Source
Eupatoroxin
KEGG COMPOUND
Manual Xrefs
Databases
C00003279
KNApSAcK
C09443
KEGG COMPOUND
View more database links
Registry Number
Type
Source
20071-51-6
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014